4-[(3,5-ditert-butyl-4-oxidanyl-phenyl)-(3-ethylphenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3,5-ditert-butyl-4-oxidanyl-phenyl)-(3-ethylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(N-(3,5-ditert-butyl-4-hydroxy-phenyl)-3-ethyl-anilino)-4-oxo-butanoic acid CAS Name: 4-(N-(3,5-ditert-butyl-4-hydroxyphenyl)-3-ethylanilino)-4-oxobutanoic acid IUPAC Name: 4-(N-(3,5-ditert-butyl-4-hydroxyphenyl)-3-ethylanilino)-4-oxobutanoic acid Traditional Name: 4-(N-(3,5-ditert-butyl-4-hydroxy-phenyl)-3-ethyl-anilino)-4-keto-butyric acid Formula: C26H35NO4 MolecularWeight: 425.5604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N(C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)CCC(=O)O

Isomeric SMILES

CCC1=CC(=CC=C1)N(C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)CCC(=O)O

InChI

InChI=1S/C26H35NO4/c1-8-17-10-9-11-18(14-17)27(22(28)12-13-23(29)30)19-15-20(25(2,3)4)24(31)21(16-19)26(5,6)7/h9-11,14-16,31H,8,12-13H2,1-7H3,(H,29,30)